Package qsardes.descriptor

# Class DescriptorExtendedTopochemIndex

java.lang.Object
qsardes.descriptor.DescriptorExtendedTopochemIndex

All Implemented Interfaces:
  `Descriptor`

Direct Known Subclasses:
  `QsarMEExtendedTopochemIndex`, `QsarWBExtendedTopochemIndex`

public abstract class DescriptorExtendedTopochemIndex extends Object implements Descriptor
Extended topochemical index descriptors abstract class.

- ## Nested Class Summary

  Nested Classes
  Modifier and Type
  Class
  Description
  `protected static final record`
  `DescriptorExtendedTopochemIndex.Eta`
  Stores eta values for extended topochemical index descriptors.

- ## Constructor Summary

  Constructors
  Modifier
  Constructor
  Description
  `protected`
  `DescriptorExtendedTopochemIndex()`

- ## Method Summary

  Modifier and Type
  Method
  Description
  `List<String>`
  `get_descriptor_names()`
  Gets descriptors names.
  `DescriptorType`
  `get_descriptor_type()`
  Gets the descriptor class type.
  `Map<String,String>`
  `get_descriptor_values(AbstractMoleculeBuilder mol_build)`
  Calculates descriptors values.
  `protected abstract double`
  `get_eta_eta_b(int atom_count, double eta_r)`
  `protected Molecule`
  `get_mol()`
  `protected abstract void`
  `standardize_nitro_groups()`
  `String`
  `toString()`

  ### Methods inherited from class java.lang.Object

  `clone, equals, finalize, getClass, hashCode, notify, notifyAll, wait, wait, wait`

- ## Constructor Details

  - ### DescriptorExtendedTopochemIndex

    protected DescriptorExtendedTopochemIndex()

- ## Method Details

  - ### toString

    public String toString()
    Overrides:
      `toString` in class `Object`

  - ### get_descriptor_type

    public DescriptorType get_descriptor_type()
    Description copied from interface: `Descriptor`
    Gets the descriptor class type.
    Specified by:
      `get_descriptor_type` in interface `Descriptor`
    Returns:
      Descriptor class type.

  - ### get_descriptor_names

    public List<String> get_descriptor_names()
    Description copied from interface: `Descriptor`
    Gets descriptors names.
    Specified by:
      `get_descriptor_names` in interface `Descriptor`
    Returns:
      Descriptor names.

  - ### get_descriptor_values

    public Map<String,String> get_descriptor_values(AbstractMoleculeBuilder mol_build)
    Description copied from interface: `Descriptor`
    Calculates descriptors values.
    Specified by:
      `get_descriptor_values` in interface `Descriptor`
    Parameters:
      `mol_build` - Molecular builder representation.
    Returns:
      Descriptor values mapped as name:value.

  - ### standardize_nitro_groups

    protected abstract void standardize_nitro_groups()

  - ### get_eta_eta_b

    protected abstract double get_eta_eta_b(int atom_count, double eta_r)

  - ### get_mol

    protected Molecule get_mol()